Structure Information
Structure

Compound Identification

SMILES

[Na+].[O-]S(=O)(=O)C1=CC=C(O1)\C=N\N1C=NC2=C(NC3=C2C=C(Br)C=C3)C1=O

InChIKey

InChIKey=NTTDGFZGYYZHCQ-TWFGXWKLSA-M

Formula

C15H8BrN4NaO5S

Mass

459.21

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Pyrrolopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrrolopyrimidine - Indole or derivatives - Indole - Arylsulfonic acid or derivatives - Pyrimidone - Pyrimidine - Benzenoid - Aryl halide - Aryl bromide - Organosulfonic acid - Heteroaromatic compound - Organosulfonic acid or derivatives - Pyrrole - Organic sulfonic acid or derivatives - Furan - Sulfonyl - Lactam - Organic metal halide - Oxacycle - Azacycle - Organic alkali metal salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic sodium salt - Organic salt - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrrolopyrimidines. These are compounds containing a pyrrolopyrimidine moiety, which consists of a pyrrole ring fused to a pyrimidine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.

External Descriptors

Not available

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